SCHEMBL30487458

SCHEMBL30487458

CC(C)C[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TERT O14746 1/20 0.51
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
PRCP P42785 2/20 0.44
PSMB5 P28074 3/20 0.43
ALDH1A1 P00352 2/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.40
DPP7 Q9UHL4 1/20 0.40
KDM4E B2RXH2 1/20 0.40
TLR2 O60603 2/20 0.38
HTR2C P28335 2/20 0.37
CTSC P53634 1/20 0.37
HTR2B P41595 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29570472 1.00 TERT (0.51) TERTMEN1KMT2APRCPPSMB5
SCHEMBL29906308 0.91 MEN1 (0.43) TERTMEN1KMT2APRCPPSMB5
SCHEMBL30099556 0.90 TERT (0.42) TERTMEN1KMT2APRCPPSMB5
SCHEMBL31518654 0.89 TERT (0.42) TERTMEN1KMT2APRCPPSMB5
SCHEMBL29388130 0.88 TERT (0.41) TERTMEN1KMT2APRCPPSMB5
SCHEMBL30099495 0.88 MEN1 (0.41) TERTMEN1KMT2APRCPPSMB5
SCHEMBL6373762 0.87 MEN1 (0.49) MEN1KMT2APRCPALDH1A1LMNA
SCHEMBL22295667 0.87 MEN1 (0.49) MEN1KMT2APRCPALDH1A1LMNA
SCHEMBL3041931 0.87 MEN1 (0.49) MEN1KMT2APRCPALDH1A1LMNA
SCHEMBL30729296 0.87 MEN1 (0.49) MEN1KMT2APRCPALDH1A1LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116836224-A Tetrapeptide compound TP-5, and preparation method and application thereof 兰州大学 2023-10-03 CN disclosed
CN-116574155-A Tetrapeptide compound TP-4, preparation method and application 兰州大学 2023-08-11 CN disclosed
CN-116535462-A Tetrapeptide compound TP-6, and preparation method and application thereof 兰州大学 2023-08-04 CN disclosed
CN-116535461-A Tetrapeptide compound TP-3, preparation method and application 兰州大学 2023-08-04 CN disclosed